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E55

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CABCATsing1.53Å1.53Å
CABHAB1sing1.09Å1.10Å
CABHAB2sing1.09Å1.10Å
CABHAB3sing1.09Å1.10Å
CATCAZsing1.53Å1.52Å
CATHAT1sing1.09Å1.10Å
CATHAT2sing1.09Å1.10Å
CAZCBFsing1.53Å1.50Å
CAZHAZ1sing1.09Å1.10Å
CAZHAZ2sing1.09Å1.10Å
CBFCBJsing1.53Å1.51Å
CBFHBF1sing1.09Å1.10Å
CBFHBF2sing1.09Å1.10Å
CBJCBMsing1.53Å1.51Å
CBJHBJ1sing1.09Å1.10Å
CBJHBJ2sing1.09Å1.10Å
CBMCBPsing1.53Å1.51Å
CBMHBM1sing1.09Å1.10Å
CBMHBM2sing1.09Å1.10Å
CBPCBRsing1.53Å1.53Å
CBPHBP1sing1.09Å1.10Å
CBPHBP2sing1.09Å1.10Å
CBRCBUsing1.53Å1.51Å
CBRHBR1sing1.09Å1.10Å
CBRHBR2sing1.09Å1.10Å
CBUCBYsing1.53Å1.51Å
CBUHBU1sing1.09Å1.10Å
CBUHBU2sing1.09Å1.10Å
CBYCCDsing1.53Å1.53Å
CBYHBY1sing1.09Å1.10Å
CBYHBY2sing1.09Å1.10Å
CCDCCVsing1.51Å1.50Å
CCDHCD1sing1.09Å1.10Å
CCDHCD2sing1.09Å1.10Å
CCVCCHsing1.51Å1.52Å
CCVOAGdoub1.21Å1.22Å
CCHCCXsing1.51Å1.53Å
CCHHCH1sing1.09Å1.10Å
CCHHCH2sing1.09Å1.10Å
CCXN2sing1.35Å1.32Å
CCXOAIdoub1.21Å1.23Å
N2C2sing1.47Å1.45Å
N2HN2sing0.97Å1.00Å
C2C1sing1.53Å1.53Å
C2C3sing1.53Å1.53Å
C2H2sing1.09Å1.10Å
C3O3sing1.43Å1.43Å
C3C4sing1.53Å1.51Å
C3H3sing1.09Å1.10Å
C4C5sing1.53Å1.55Å
C4O4sing1.43Å1.43Å
C4H4sing1.09Å1.10Å
O4HO4sing0.97Å0.95Å
O3CCBsing1.43Å1.46Å
CCBCBXsing1.53Å1.54Å
CCBHCB1sing1.09Å1.10Å
CCBHCB2sing1.09Å1.10Å
CBXCBTsing1.53Å1.54Å
CBXHBX1sing1.09Å1.10Å
CBXHBX2sing1.09Å1.10Å
CBTCBQsing1.53Å1.54Å
CBTHBT1sing1.09Å1.10Å
CBTHBT2sing1.09Å1.10Å
CBQCBNsing1.53Å1.53Å
CBQHBQ1sing1.09Å1.10Å
CBQHBQ2sing1.09Å1.10Å
CBNCBKsing1.53Å1.55Å
CBNHBN1sing1.09Å1.10Å
CBNHBN2sing1.09Å1.10Å
CBKCBGsing1.53Å1.55Å
CBKHBK1sing1.09Å1.10Å
CBKHBK2sing1.09Å1.10Å
CBGCBAsing1.53Å1.54Å
CBGHBG1sing1.09Å1.10Å
CBGHBG2sing1.09Å1.10Å
CBACAUsing1.53Å1.54Å
CBAHBA1sing1.09Å1.10Å
CBAHBA2sing1.09Å1.10Å
CAUCACsing1.53Å1.53Å
CAUHAU1sing1.09Å1.10Å
CAUHAU2sing1.09Å1.10Å
CACHAC1sing1.09Å1.10Å
CACHAC2sing1.09Å1.10Å
CACHAC3sing1.09Å1.10Å
C1O5sing1.43Å1.44Å
C1O1sing1.43Å1.42Å
C1H1sing1.09Å1.10Å
O1PDJsing1.61Å1.60Å
PDJOAMsing1.61Å1.60Å
PDJOANsing1.61Å1.59Å
PDJOAJdoub1.48Å1.48Å
OAMHAMsing0.97Å0.95Å
OANHANsing0.97Å0.95Å
O5C5sing1.43Å1.43Å
C5C6sing1.53Å1.54Å
C5H5sing1.09Å1.10Å
C6O6sing1.43Å1.46Å
C6H61sing1.09Å1.10Å
C6H62sing1.09Å1.10Å
O6CDCsing1.43Å1.46Å
CDCCDEsing1.53Å1.53Å
CDCOCRsing1.43Å1.48Å
CDCHDCsing1.09Å1.10Å
OCRCDBsing1.43Å1.43Å
CDBCCIsing1.53Å1.50Å
CDBCDIsing1.53Å1.53Å
CDBHDBsing1.09Å1.10Å
CCIOCMsing1.43Å1.45Å
CCIHCI1sing1.09Å1.10Å
CCIHCI2sing1.09Å1.10Å
OCMCAEsing1.43Å1.45Å
CAEHAE1sing1.09Å1.10Å
CAEHAE2sing1.09Å1.10Å
CAEHAE3sing1.09Å1.10Å
CDIOCUsing1.43Å1.43Å
CDICDHsing1.53Å1.56Å
CDIHDIsing1.09Å1.10Å
OCUPDKsing1.61Å1.61Å
PDKOAOsing1.61Å1.63Å
PDKOAPsing1.61Å1.62Å
PDKOAKdoub1.48Å1.49Å
OAOHAOsing0.97Å0.95Å
OAPHAPsing0.97Å0.95Å
CDHCDEsing1.53Å1.53Å
CDHOCPsing1.43Å1.44Å
CDHHDHsing1.09Å1.10Å
OCPCCCsing1.43Å1.46Å
CCCCCGsing1.53Å1.55Å
CCCHCC1sing1.09Å1.10Å
CCCHCC2sing1.09Å1.10Å
CCGCCYsing1.53Å1.54Å
CCGHCG1sing1.09Å1.10Å
CCGHCG2sing1.09Å1.10Å
CCYCCFsing1.53Å1.52Å
CCYOCNsing1.43Å1.42Å
CCYHCYsing1.09Å1.10Å
OCNCAFsing1.43Å1.44Å
CAFHAF1sing1.09Å1.10Å
CAFHAF2sing1.09Å1.10Å
CAFHAF3sing1.09Å1.10Å
CCFCCAsing1.53Å1.52Å
CCFHCF1sing1.09Å1.10Å
CCFHCF2sing1.09Å1.10Å
CCACBWsing1.53Å1.53Å
CCAHCA1sing1.09Å1.10Å
CCAHCA2sing1.09Å1.10Å
CBWCBHsing1.53Å1.52Å
CBWHBW1sing1.09Å1.10Å
CBWHBW2sing1.09Å1.10Å
CBHCBBsing1.53Å1.53Å
CBHHBH1sing1.09Å1.10Å
CBHHBH2sing1.09Å1.10Å
CBBCAVsing1.53Å1.54Å
CBBHBB1sing1.09Å1.10Å
CBBHBB2sing1.09Å1.10Å
CAVCADsing1.53Å1.54Å
CAVHAV1sing1.09Å1.10Å
CAVHAV2sing1.09Å1.10Å
CADHAD1sing1.09Å1.10Å
CADHAD2sing1.09Å1.10Å
CADHAD3sing1.09Å1.10Å
CDENCKsing1.46Å1.47Å
CDEHDEsing1.09Å1.10Å
NCKCCWsing1.35Å1.33Å
NCKHCKsing0.97Å1.00Å
CCWCCEsing1.51Å1.52Å
CCWOAHdoub1.21Å1.23Å
CCECBZsing1.53Å1.51Å
CCEHCE1sing1.09Å1.10Å
CCEHCE2sing1.09Å1.10Å
CBZCBVsing1.53Å1.53Å
CBZHBZ1sing1.09Å1.10Å
CBZHBZ2sing1.09Å1.10Å
CBVCBSsing1.53Å1.54Å
CBVHBV1sing1.09Å1.10Å
CBVHBV2sing1.09Å1.10Å
CBSCBOsing1.53Å1.55Å
CBSHBS1sing1.09Å1.10Å
CBSHBS2sing1.09Å1.10Å
CBOCBLsing1.53Å1.53Å
CBOHBO1sing1.09Å1.10Å
CBOHBO2sing1.09Å1.10Å
CBLCBIsing1.53Å1.53Å
CBLHBL1sing1.09Å1.10Å
CBLHBL2sing1.09Å1.10Å
CBICBDsing1.53Å1.54Å
CBIHBI1sing1.09Å1.10Å
CBIHBI2sing1.09Å1.10Å
CBDCAXsing1.53Å1.53Å
CBDHBD1sing1.09Å1.10Å
CBDHBD2sing1.09Å1.10Å
CAXCARsing1.51Å1.40Å
CAXHAX1sing1.09Å1.10Å
CAXHAX2sing1.09Å1.10Å
CARCAQdoub1.31Å1.40Å
CARHARsing1.08Å1.08Å
CAQCAWsing1.51Å1.39Å
CAQHAQsing1.08Å1.08Å
CAWCBCsing1.53Å1.54Å
CAWHAW1sing1.09Å1.10Å
CAWHAW2sing1.09Å1.10Å
CBCCBEsing1.53Å1.54Å
CBCHBC1sing1.09Å1.10Å
CBCHBC2sing1.09Å1.10Å
CBECAYsing1.53Å1.54Å
CBEHBE1sing1.09Å1.10Å
CBEHBE2sing1.09Å1.10Å
CAYCASsing1.53Å1.52Å
CAYHAY1sing1.09Å1.10Å
CAYHAY2sing1.09Å1.10Å
CASCAAsing1.53Å1.52Å
CASHAS1sing1.09Å1.10Å
CASHAS2sing1.09Å1.10Å
CAAHAA1sing1.09Å1.10Å
CAAHAA2sing1.09Å1.10Å
CAAHAA3sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CATCABHAB1109.5°109.5°
CATCABHAB2109.4°109.4°
CATCABHAB3109.5°109.5°
CABCATCAZ109.5°109.5°
CABCATHAT1109.5°109.4°
CABCATHAT2109.4°109.5°
HAB1CABHAB2109.5°109.5°
HAB1CABHAB3109.5°109.5°
HAB2CABHAB3109.5°109.5°
CAZCATHAT1109.4°109.5°
CAZCATHAT2109.4°109.5°
CATCAZCBF107.1°109.5°
CATCAZHAZ1110.3°109.4°
CATCAZHAZ2110.8°109.4°
HAT1CATHAT2109.5°109.5°
CBFCAZHAZ1110.3°109.5°
CBFCAZHAZ2110.8°109.5°
CAZCBFCBJ108.8°109.5°
CAZCBFHBF1109.7°109.5°
CAZCBFHBF2109.8°109.5°
HAZ1CAZHAZ2107.6°109.4°
CBJCBFHBF1109.7°109.5°
CBJCBFHBF2109.9°109.5°
CBFCBJCBM108.9°109.5°
CBFCBJHBJ1109.7°109.5°
CBFCBJHBJ2109.8°109.5°
HBF1CBFHBF2108.9°109.5°
CBMCBJHBJ1109.7°109.5°
CBMCBJHBJ2109.8°109.5°
CBJCBMCBP107.9°109.5°
CBJCBMHBM1110.0°109.5°
CBJCBMHBM2110.4°109.5°
HBJ1CBJHBJ2109.0°109.5°
CBPCBMHBM1110.0°109.5°
CBPCBMHBM2110.3°109.5°
CBMCBPCBR108.7°109.5°
CBMCBPHBP1109.7°109.5°
CBMCBPHBP2109.9°109.5°
HBM1CBMHBM2108.2°109.5°
CBRCBPHBP1109.8°109.5°
CBRCBPHBP2109.9°109.4°
CBPCBRCBU109.2°109.5°
CBPCBRHBR1109.6°109.5°
CBPCBRHBR2109.6°109.4°
HBP1CBPHBP2108.8°109.4°
CBUCBRHBR1109.6°109.5°
CBUCBRHBR2109.6°109.5°
CBRCBUCBY110.8°109.5°
CBRCBUHBU1109.0°109.5°
CBRCBUHBU2108.7°109.5°
HBR1CBRHBR2109.3°109.5°
CBYCBUHBU1109.1°109.5°
CBYCBUHBU2108.8°109.5°
CBUCBYCCD107.3°109.5°
CBUCBYHBY1110.2°109.5°
CBUCBYHBY2110.7°109.5°
HBU1CBUHBU2110.5°109.5°
CCDCBYHBY1110.2°109.5°
CCDCBYHBY2110.7°109.4°
CBYCCDCCV110.2°109.5°
CBYCCDHCD1109.2°109.5°
CBYCCDHCD2109.1°109.5°
HBY1CBYHBY2107.8°109.5°
CCVCCDHCD1109.2°109.5°
CCVCCDHCD2109.1°109.5°
CCDCCVCCH120.9°120.0°
CCDCCVOAG119.0°120.0°
HCD1CCDHCD2110.1°109.5°
CCHCCVOAG120.1°120.0°
CCVCCHCCX105.4°109.4°
CCVCCHHCH1110.9°109.5°
CCVCCHHCH2111.8°109.4°
CCXCCHHCH1110.9°109.5°
CCXCCHHCH2111.7°109.4°
CCHCCXN2113.7°120.0°
CCHCCXOAI121.4°120.0°
HCH1CCHHCH2106.3°109.5°
N2CCXOAI124.9°120.0°
CCXN2C2123.3°120.0°
CCXN2HN2118.3°120.0°
C2N2HN2118.3°120.0°
N2C2C1109.5°109.5°
N2C2C3107.3°109.5°
N2C2H2111.9°109.5°
C1C2C3112.4°109.2°
C1C2H2106.7°109.5°
C2C1O5114.8°109.4°
C2C1O1111.1°109.5°
C2C1H1102.8°109.5°
C3C2H2109.0°109.6°
C2C3O3115.4°109.6°
C2C3C4103.8°109.0°
C2C3H3106.6°109.6°
O3C3C498.7°109.5°
O3C3H3111.1°109.5°
C3O3CCB114.8°114.0°
C4C3H3121.5°109.6°
C3C4C5112.5°109.2°
C3C4O4107.7°109.5°
C3C4H4109.1°109.5°
C5C4O4110.7°109.5°
C5C4H4106.0°109.5°
C4C5O5109.3°109.4°
C4C5C6109.1°109.5°
C4C5H5109.8°109.5°
O4C4H4111.0°109.6°
C4O4HO4109.5°114.0°
O3CCBCBX105.9°109.5°
O3CCBHCB1110.7°109.4°
O3CCBHCB2111.5°109.5°
CBXCCBHCB1110.7°109.4°
CBXCCBHCB2111.4°109.5°
CCBCBXCBT115.1°109.5°
CCBCBXHBX1107.6°109.4°
CCBCBXHBX2106.3°109.5°
HCB1CCBHCB2106.8°109.5°
CBTCBXHBX1107.7°109.4°
CBTCBXHBX2106.4°109.5°
CBXCBTCBQ107.3°109.4°
CBXCBTHBT1110.2°109.4°
CBXCBTHBT2110.7°109.5°
HBX1CBXHBX2114.0°109.5°
CBQCBTHBT1110.2°109.5°
CBQCBTHBT2110.7°109.5°
CBTCBQCBN113.2°109.4°
CBTCBQHBQ1108.3°109.5°
CBTCBQHBQ2107.4°109.5°
HBT1CBTHBT2107.8°109.5°
CBNCBQHBQ1108.2°109.5°
CBNCBQHBQ2107.4°109.5°
CBQCBNCBK113.1°109.4°
CBQCBNHBN1108.3°109.5°
CBQCBNHBN2107.5°109.4°
HBQ1CBQHBQ2112.4°109.5°
CBKCBNHBN1108.3°109.5°
CBKCBNHBN2107.4°109.5°
CBNCBKCBG111.5°109.4°
CBNCBKHBK1108.8°109.5°
CBNCBKHBK2108.3°109.5°
HBN1CBNHBN2112.3°109.5°
CBGCBKHBK1108.8°109.5°
CBGCBKHBK2108.4°109.5°
CBKCBGCBA114.6°109.4°
CBKCBGHBG1107.8°109.5°
CBKCBGHBG2106.6°109.4°
HBK1CBKHBK2111.0°109.5°
CBACBGHBG1107.8°109.5°
CBACBGHBG2106.6°109.5°
CBGCBACAU107.9°109.4°
CBGCBAHBA1110.0°109.4°
CBGCBAHBA2110.3°109.5°
HBG1CBGHBG2113.6°109.5°
CAUCBAHBA1110.0°109.5°
CAUCBAHBA2110.3°109.5°
CBACAUCAC113.2°109.4°
CBACAUHAU1108.3°109.4°
CBACAUHAU2107.4°109.4°
HBA1CBAHBA2108.3°109.5°
CACCAUHAU1108.2°109.5°
CACCAUHAU2107.4°109.5°
CAUCACHAC1109.5°109.5°
CAUCACHAC2109.5°109.5°
CAUCACHAC3109.4°109.5°
HAU1CAUHAU2112.4°109.5°
HAC1CACHAC2109.5°109.5°
HAC1CACHAC3109.5°109.5°
HAC2CACHAC3109.5°109.4°
O5C1O1102.9°109.5°
O5C1H1111.0°109.5°
C1O5C5115.9°114.1°
O1C1H1114.7°109.5°
C1O1PDJ117.8°123.0°
O1PDJOAM102.1°109.5°
O1PDJOAN103.6°109.5°
O1PDJOAJ115.7°109.5°
OAMPDJOAN109.5°109.5°
OAMPDJOAJ112.9°109.4°
PDJOAMHAM109.5°114.0°
OANPDJOAJ112.2°109.5°
PDJOANHAN109.5°114.0°
O5C5C6109.4°109.5°
O5C5H5109.5°109.4°
C6C5H5109.7°109.5°
C5C6O6103.4°109.5°
C5C6H61111.6°109.5°
C5C6H62112.8°109.5°
O6C6H61111.6°109.5°
O6C6H62112.8°109.5°
C6O6CDC112.7°114.0°
H61C6H62104.9°109.5°
O6CDCCDE113.1°109.5°
O6CDCOCR113.0°109.5°
O6CDCHDC103.4°109.5°
CDECDCOCR106.3°109.5°
CDECDCHDC110.5°109.4°
CDCCDECDH110.2°109.2°
CDCCDENCK110.7°109.6°
CDCCDEHDE108.1°109.5°
OCRCDCHDC110.6°109.5°
CDCOCRCDB110.3°114.1°
OCRCDBCCI105.2°109.5°
OCRCDBCDI107.5°109.4°
OCRCDBHDB114.9°109.5°
CCICDBCDI113.5°109.4°
CCICDBHDB109.1°109.5°
CDBCCIOCM109.0°109.4°
CDBCCIHCI1109.7°109.4°
CDBCCIHCI2109.8°109.5°
CDICDBHDB106.8°109.5°
CDBCDIOCU108.8°109.5°
CDBCDICDH112.7°109.1°
CDBCDIHDI108.0°109.5°
OCMCCIHCI1109.6°109.5°
OCMCCIHCI2109.8°109.5°
CCIOCMCAE109.7°114.0°
HCI1CCIHCI2109.1°109.5°
OCMCAEHAE1109.5°109.5°
OCMCAEHAE2109.5°109.5°
OCMCAEHAE3109.4°109.4°
HAE1CAEHAE2109.4°109.5°
HAE1CAEHAE3109.5°109.5°
HAE2CAEHAE3109.5°109.4°
OCUCDICDH110.1°109.5°
OCUCDIHDI110.6°109.5°
CDIOCUPDK121.3°123.0°
CDHCDIHDI106.6°109.6°
CDICDHCDE113.3°109.0°
CDICDHOCP111.7°109.6°
CDICDHHDH103.8°109.5°
OCUPDKOAO106.2°109.5°
OCUPDKOAP101.7°109.5°
OCUPDKOAK114.7°109.4°
OAOPDKOAP106.2°109.5°
OAOPDKOAK110.9°109.5°
PDKOAOHAO109.5°114.0°
OAPPDKOAK116.2°109.5°
PDKOAPHAP109.5°113.9°
CDECDHOCP104.5°109.5°
CDECDHHDH111.1°109.5°
CDHCDENCK109.3°109.5°
CDHCDEHDE109.5°109.5°
OCPCDHHDH112.7°109.6°
CDHOCPCCC113.9°114.0°
OCPCCCCCG114.5°109.5°
OCPCCCHCC1107.8°109.4°
OCPCCCHCC2106.7°109.5°
CCGCCCHCC1107.9°109.4°
CCGCCCHCC2106.7°109.5°
CCCCCGCCY109.7°109.5°
CCCCCGHCG1109.4°109.4°
CCCCCGHCG2109.4°109.5°
HCC1CCCHCC2113.5°109.5°
CCYCCGHCG1109.4°109.4°
CCYCCGHCG2109.4°109.5°
CCGCCYCCF108.7°109.5°
CCGCCYOCN109.1°109.4°
CCGCCYHCY109.6°109.5°
HCG1CCGHCG2109.6°109.5°
CCFCCYOCN107.6°109.4°
CCFCCYHCY111.1°109.5°
CCYCCFCCA113.8°109.4°
CCYCCFHCF1108.1°109.4°
CCYCCFHCF2107.1°109.5°
OCNCCYHCY110.7°109.5°
CCYOCNCAF109.5°114.0°
OCNCAFHAF1109.5°109.5°
OCNCAFHAF2109.4°109.5°
OCNCAFHAF3109.5°109.5°
HAF1CAFHAF2109.5°109.4°
HAF1CAFHAF3109.4°109.5°
HAF2CAFHAF3109.5°109.5°
CCACCFHCF1108.1°109.4°
CCACCFHCF2107.1°109.5°
CCFCCACBW108.7°109.4°
CCFCCAHCA1109.7°109.5°
CCFCCAHCA2109.9°109.5°
HCF1CCFHCF2112.9°109.5°
CBWCCAHCA1109.7°109.5°
CBWCCAHCA2109.9°109.5°
CCACBWCBH110.3°109.5°
CCACBWHBW1109.2°109.5°
CCACBWHBW2109.0°109.5°
HCA1CCAHCA2108.9°109.5°
CBHCBWHBW1109.2°109.4°
CBHCBWHBW2109.0°109.5°
CBWCBHCBB110.4°109.5°
CBWCBHHBH1109.2°109.4°
CBWCBHHBH2109.0°109.5°
HBW1CBWHBW2110.1°109.5°
CBBCBHHBH1109.2°109.5°
CBBCBHHBH2108.9°109.5°
CBHCBBCAV111.1°109.4°
CBHCBBHBB1108.9°109.5°
CBHCBBHBB2108.5°109.4°
HBH1CBHHBH2110.2°109.5°
CAVCBBHBB1108.9°109.5°
CAVCBBHBB2108.6°109.5°
CBBCAVCAD111.5°109.5°
CBBCAVHAV1108.8°109.4°
CBBCAVHAV2108.4°109.5°
HBB1CBBHBB2110.8°109.5°
CADCAVHAV1108.8°109.5°
CADCAVHAV2108.3°109.5°
CAVCADHAD1109.5°109.5°
CAVCADHAD2109.5°109.5°
CAVCADHAD3109.4°109.5°
HAV1CAVHAV2111.1°109.5°
HAD1CADHAD2109.4°109.4°
HAD1CADHAD3109.5°109.5°
HAD2CADHAD3109.5°109.5°
NCKCDEHDE109.0°109.5°
CDENCKCCW122.8°120.0°
CDENCKHCK118.6°120.0°
CCWNCKHCK118.6°120.0°
NCKCCWCCE115.4°120.0°
NCKCCWOAH123.7°120.0°
CCECCWOAH120.9°120.0°
CCWCCECBZ110.1°109.5°
CCWCCEHCE1109.3°109.4°
CCWCCEHCE2109.2°109.5°
CBZCCEHCE1109.3°109.5°
CBZCCEHCE2109.1°109.5°
CCECBZCBV111.0°109.5°
CCECBZHBZ1109.0°109.5°
CCECBZHBZ2108.6°109.5°
HCE1CCEHCE2109.9°109.4°
CBVCBZHBZ1109.0°109.5°
CBVCBZHBZ2108.6°109.4°
CBZCBVCBS109.1°109.5°
CBZCBVHBV1109.6°109.5°
CBZCBVHBV2109.7°109.5°
HBZ1CBZHBZ2110.7°109.5°
CBSCBVHBV1109.6°109.5°
CBSCBVHBV2109.7°109.4°
CBVCBSCBO112.1°109.5°
CBVCBSHBS1108.6°109.5°
CBVCBSHBS2108.1°109.4°
HBV1CBVHBV2109.2°109.4°
CBOCBSHBS1108.6°109.5°
CBOCBSHBS2108.0°109.4°
CBSCBOCBL109.4°109.5°
CBSCBOHBO1109.5°109.5°
CBSCBOHBO2109.5°109.5°
HBS1CBSHBS2111.5°109.5°
CBLCBOHBO1109.5°109.5°
CBLCBOHBO2109.5°109.4°
CBOCBLCBI112.6°109.5°
CBOCBLHBL1108.4°109.4°
CBOCBLHBL2107.7°109.4°
HBO1CBOHBO2109.5°109.4°
CBICBLHBL1108.4°109.5°
CBICBLHBL2107.7°109.5°
CBLCBICBD111.2°109.5°
CBLCBIHBI1108.9°109.5°
CBLCBIHBI2108.5°109.4°
HBL1CBLHBL2112.0°109.5°
CBDCBIHBI1108.9°109.5°
CBDCBIHBI2108.5°109.5°
CBICBDCAX111.2°109.4°
CBICBDHBD1108.9°109.5°
CBICBDHBD2108.5°109.4°
HBI1CBIHBI2110.8°109.5°
CAXCBDHBD1108.9°109.5°
CAXCBDHBD2108.5°109.5°
CBDCAXCAR111.4°109.4°
CBDCAXHAX1108.8°109.5°
CBDCAXHAX2108.4°109.5°
HBD1CBDHBD2110.9°109.5°
CARCAXHAX1108.8°109.5°
CARCAXHAX2108.4°109.5°
CAXCARCAQ123.1°120.0°
CAXCARHAR118.4°120.0°
HAX1CAXHAX2111.0°109.5°
CAQCARHAR118.5°120.0°
CARCAQCAW121.5°120.0°
CARCAQHAQ119.2°120.1°
CAWCAQHAQ119.2°120.0°
CAQCAWCBC112.0°109.5°
CAQCAWHAW1108.7°109.4°
CAQCAWHAW2108.1°109.5°
CBCCAWHAW1108.7°109.5°
CBCCAWHAW2108.1°109.5°
CAWCBCCBE111.5°109.5°
CAWCBCHBC1108.8°109.5°
CAWCBCHBC2108.3°109.5°
HAW1CAWHAW2111.4°109.5°
CBECBCHBC1108.8°109.4°
CBECBCHBC2108.3°109.5°
CBCCBECAY111.1°109.5°
CBCCBEHBE1108.9°109.4°
CBCCBEHBE2108.6°109.5°
HBC1CBCHBC2111.1°109.5°
CAYCBEHBE1108.9°109.5°
CAYCBEHBE2108.6°109.5°
CBECAYCAS110.4°109.5°
CBECAYHAY1109.2°109.5°
CBECAYHAY2109.0°109.5°
HBE1CBEHBE2110.7°109.5°
CASCAYHAY1109.2°109.5°
CASCAYHAY2109.0°109.4°
CAYCASCAA109.7°109.5°
CAYCASHAS1109.4°109.5°
CAYCASHAS2109.4°109.4°
HAY1CAYHAY2110.2°109.5°
CAACASHAS1109.4°109.5°
CAACASHAS2109.4°109.5°
CASCAAHAA1109.5°109.5°
CASCAAHAA2109.5°109.5°
CASCAAHAA3109.5°109.5°
HAS1CASHAS2109.6°109.4°
HAA1CAAHAA2109.5°109.5°
HAA1CAAHAA3109.4°109.4°
HAA2CAAHAA3109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CATCABHAB1HAB2120.0°120.0°
CATCABHAB1HAB3120.0°120.0°
CATCABHAB2HAB3120.0°120.0°
CABCATCAZHAT1120.0°120.0°
CABCATCAZHAT2120.0°120.0°
CABCATHAT1HAT2120.0°120.0°
CABCATCAZCBF158.7°180.0°
CABCATCAZHAZ181.3°60.0°
CABCATCAZHAZ237.8°59.9°
HAB1CABHAB2HAB3120.0°120.0°
HAB1CABCATCAZ155.8°60.0°
HAB1CABCATHAT135.8°60.0°
HAB1CABCATHAT284.3°NaN°
HAB2CABCATCAZ35.7°60.0°
HAB2CABCATHAT184.2°NaN°
HAB2CABCATHAT2155.7°60.0°
HAB3CABCATCAZ84.2°180.0°
HAB3CABCATHAT1155.8°60.0°
HAB3CABCATHAT235.8°60.0°
CAZCATHAT1HAT2120.0°120.0°
CATCAZCBFHAZ1120.0°120.0°
CATCAZCBFHAZ2120.9°120.0°
CATCAZHAZ1HAZ2121.0°119.9°
CATCAZCBFCBJ177.1°180.0°
CATCAZCBFHBF162.9°60.0°
CATCAZCBFHBF256.8°60.0°
HAT1CATCAZCBF38.7°60.0°
HAT1CATCAZHAZ1158.7°180.0°
HAT1CATCAZHAZ282.3°60.0°
HAT2CATCAZCBF81.3°60.0°
HAT2CATCAZHAZ138.7°60.0°
HAT2CATCAZHAZ2157.7°179.9°
CBFCAZHAZ1HAZ2121.0°120.1°
CAZCBFCBJHBF1120.0°120.0°
CAZCBFCBJHBF2120.3°120.0°
CAZCBFHBF1HBF2120.2°120.0°
CAZCBFCBJCBM155.2°180.0°
CAZCBFCBJHBJ135.2°60.0°
CAZCBFCBJHBJ284.5°60.0°
HAZ1CAZCBFCBJ57.1°60.0°
HAZ1CAZCBFHBF1177.1°180.0°
HAZ1CAZCBFHBF263.2°60.0°
HAZ2CAZCBFCBJ62.0°60.0°
HAZ2CAZCBFHBF158.1°60.0°
HAZ2CAZCBFHBF2177.8°180.0°
CBJCBFHBF1HBF2120.3°120.0°
CBFCBJCBMHBJ1120.0°120.0°
CBFCBJCBMHBJ2120.2°120.0°
CBFCBJHBJ1HBJ2120.2°120.0°
CBFCBJCBMCBP160.8°180.0°
CBFCBJCBMHBM140.8°60.0°
CBFCBJCBMHBM278.6°60.0°
HBF1CBFCBJCBM84.8°60.0°
HBF1CBFCBJHBJ1155.2°NaN°
HBF1CBFCBJHBJ235.5°60.0°
HBF2CBFCBJCBM35.0°60.0°
HBF2CBFCBJHBJ185.0°60.0°
HBF2CBFCBJHBJ2155.2°180.0°
CBMCBJHBJ1HBJ2120.3°120.0°
CBJCBMCBPHBM1120.0°120.0°
CBJCBMCBPHBM2120.6°120.0°
CBJCBMHBM1HBM2120.6°120.0°
CBJCBMCBPCBR173.3°180.0°
CBJCBMCBPHBP166.7°60.0°
CBJCBMCBPHBP252.9°60.0°
HBJ1CBJCBMCBP79.2°60.0°
HBJ1CBJCBMHBM1160.8°180.0°
HBJ1CBJCBMHBM241.4°60.0°
HBJ2CBJCBMCBP40.6°60.0°
HBJ2CBJCBMHBM179.5°60.0°
HBJ2CBJCBMHBM2161.2°180.0°
CBPCBMHBM1HBM2120.6°120.0°
CBMCBPCBRHBP1120.0°120.1°
CBMCBPCBRHBP2120.3°120.0°
CBMCBPHBP1HBP2120.3°120.0°
CBMCBPCBRCBU166.3°180.0°
CBMCBPCBRHBR173.6°60.0°
CBMCBPCBRHBR246.3°60.0°
HBM1CBMCBPCBR53.3°60.0°
HBM1CBMCBPHBP1173.3°180.0°
HBM1CBMCBPHBP267.1°60.0°
HBM2CBMCBPCBR66.1°60.0°
HBM2CBMCBPHBP153.9°60.0°
HBM2CBMCBPHBP2173.6°180.0°
CBRCBPHBP1HBP2120.3°119.9°
CBPCBRCBUHBR1120.0°120.0°
CBPCBRCBUHBR2120.1°120.0°
CBPCBRHBR1HBR2120.1°119.9°
CBPCBRCBUCBY176.8°180.0°
CBPCBRCBUHBU156.8°60.0°
CBPCBRCBUHBU263.8°60.0°
HBP1CBPCBRCBU46.4°59.9°
HBP1CBPCBRHBR1166.4°179.9°
HBP1CBPCBRHBR273.7°60.1°
HBP2CBPCBRCBU73.3°60.0°
HBP2CBPCBRHBR146.7°60.0°
HBP2CBPCBRHBR2166.6°180.0°
CBUCBRHBR1HBR2120.1°120.0°
CBRCBUCBYHBU1120.0°120.0°
CBRCBUCBYHBU2119.5°120.0°
CBRCBUHBU1HBU2119.5°120.0°
CBRCBUCBYCCD173.1°180.0°
CBRCBUCBYHBY153.1°60.0°
CBRCBUCBYHBY266.1°60.0°
HBR1CBRCBUCBY63.2°60.0°
HBR1CBRCBUHBU1176.8°180.0°
HBR1CBRCBUHBU256.3°60.0°
HBR2CBRCBUCBY56.7°60.0°
HBR2CBRCBUHBU163.4°60.0°
HBR2CBRCBUHBU2176.1°180.0°
CBYCBUHBU1HBU2119.5°120.0°
CBUCBYCCDHBY1120.0°120.0°
CBUCBYCCDHBY2120.8°120.1°
CBUCBYHBY1HBY2120.9°120.1°
CBUCBYCCDCCV172.4°180.0°
CBUCBYCCDHCD167.6°60.0°
CBUCBYCCDHCD252.7°60.0°
HBU1CBUCBYCCD66.9°60.0°
HBU1CBUCBYHBY1173.1°180.0°
HBU1CBUCBYHBY254.0°60.0°
HBU2CBUCBYCCD53.6°60.0°
HBU2CBUCBYHBY166.4°60.0°
HBU2CBUCBYHBY2174.5°180.0°
CCDCBYHBY1HBY2120.9°119.9°
CBYCCDCCVHCD1120.0°120.0°
CBYCCDCCVHCD2119.7°120.0°
CBYCCDHCD1HCD2119.7°120.0°
CBYCCDCCVCCH136.6°180.0°
CBYCCDCCVOAG44.0°0.0°
HBY1CBYCCDCCV52.4°60.0°
HBY1CBYCCDHCD1172.4°180.0°
HBY1CBYCCDHCD267.3°60.0°
HBY2CBYCCDCCV66.7°59.9°
HBY2CBYCCDHCD153.3°60.0°
HBY2CBYCCDHCD2173.6°179.9°
CCVCCDHCD1HCD2119.7°120.0°
CCDCCVCCHOAG179.4°180.0°
CCDCCVCCHCCX152.0°180.0°
CCDCCVCCHHCH188.0°60.0°
CCDCCVCCHHCH230.4°60.1°
HCD1CCDCCVCCH16.7°60.0°
HCD1CCDCCVOAG163.9°120.0°
HCD2CCDCCVCCH103.6°60.0°
HCD2CCDCCVOAG75.7°120.0°
CCVCCHCCXHCH1120.0°120.0°
CCVCCHCCXHCH2121.6°119.9°
CCVCCHHCH1HCH2121.7°120.0°
CCVCCHCCXN268.5°180.0°
CCVCCHCCXOAI109.7°0.0°
OAGCCVCCHCCX27.4°0.0°
OAGCCVCCHHCH192.6°120.0°
OAGCCVCCHHCH2149.0°120.0°
CCXCCHHCH1HCH2121.7°120.0°
CCHCCXN2OAI178.2°180.0°
CCHCCXN2C2178.3°180.0°
CCHCCXN2HN21.7°0.1°
HCH1CCHCCXN2171.5°60.0°
HCH1CCHCCXOAI10.3°120.0°
HCH2CCHCCXN253.1°60.0°
HCH2CCHCCXOAI128.7°120.0°
CCXN2C2HN2180.0°179.9°
CCXN2C2C183.5°84.9°
CCXN2C2C3154.2°155.3°
CCXN2C2H234.7°35.2°
OAICCXN2C20.1°0.1°
OAICCXN2HN2179.9°180.0°
N2C2C1C3119.1°119.9°
N2C2C1H2121.4°120.1°
N2C2C3H2121.4°120.1°
N2C2C3O376.2°63.2°
N2C2C3C4177.0°176.9°
N2C2C3H347.6°57.0°
N2C2C1O5169.1°177.5°
N2C2C1O152.9°57.5°
N2C2C1H170.2°62.5°
HN2N2C2C196.5°95.0°
HN2N2C2C325.8°24.7°
HN2N2C2H2145.3°144.9°
C1C2C3H2118.1°119.9°
C1C2C3O3163.3°176.8°
C1C2C3C456.5°57.0°
C1C2C3H372.9°63.0°
C2C1O5O1120.8°120.0°
C2C1O5H1116.0°120.0°
C2C1O1H1116.0°120.0°
C2C1O1PDJ166.3°150.0°
C2C1O5C545.8°61.1°
C2C3O3C4109.8°119.5°
C2C3O3H3121.4°120.2°
C2C3C4H3119.7°119.9°
C2C3C4C562.8°57.0°
C2C3C4O4175.0°176.8°
C2C3C4H454.5°62.9°
C2C3O3CCB102.6°150.0°
C3C2C1O550.0°57.6°
C3C2C1O166.2°62.4°
C3C2C1H1170.6°177.6°
H2C2C3O345.2°56.9°
H2C2C3C461.6°62.9°
H2C2C3H3169.0°177.1°
H2C2C1O569.5°62.4°
H2C2C1O1174.3°177.6°
H2C2C1H151.2°57.6°
O3C3C4H3121.4°120.2°
O3C3C4C5178.2°176.9°
O3C3C4O456.0°63.3°
O3C3C4H464.5°57.0°
C3O3CCBCBX170.2°180.0°
C3O3CCBHCB169.8°60.0°
C3O3CCBHCB248.9°60.0°
C3C4C5O4120.5°119.9°
C3C4C5H4119.1°119.9°
C3C4O4H4119.3°120.2°
C3C4O4HO439.1°180.0°
C4C3O3CCB147.6°90.5°
C3C4C5O560.2°57.6°
C3C4C5C6179.8°177.6°
C3C4C5H559.9°62.4°
H3C3C4C556.8°62.9°
H3C3C4O465.4°56.9°
H3C3C4H4174.1°177.2°
H3C3O3CCB18.8°29.8°
C5C4O4H4117.3°120.2°
C5C4O4HO4162.4°60.3°
C4C5O5C148.9°61.1°
C4C5O5C6119.4°120.0°
C4C5O5H5120.4°120.0°
C4C5C6H5120.3°120.0°
C4C5C6O636.1°175.0°
C4C5C6H61156.1°55.0°
C4C5C6H6286.1°65.0°
O4C4C5O5179.3°177.5°
O4C4C5C659.7°62.5°
O4C4C5H560.6°57.5°
H4C4O4HO480.2°59.8°
H4C4C5O558.9°62.3°
H4C4C5C660.7°57.7°
H4C4C5H5179.1°177.7°
O3CCBCBXHCB1120.0°119.9°
O3CCBCBXHCB2121.4°120.0°
O3CCBHCB1HCB2121.5°120.0°
O3CCBCBXCBT169.6°180.0°
O3CCBCBXHBX149.6°60.1°
O3CCBCBXHBX272.9°59.9°
CBXCCBHCB1HCB2121.5°120.0°
CCBCBXCBTHBX1120.0°119.9°
CCBCBXCBTHBX2117.5°120.1°
CCBCBXHBX1HBX2117.7°120.0°
CCBCBXCBTCBQ140.9°180.0°
CCBCBXCBTHBT199.1°60.1°
CCBCBXCBTHBT220.0°60.0°
HCB1CCBCBXCBT70.4°60.1°
HCB1CCBCBXHBX1169.6°180.0°
HCB1CCBCBXHBX247.0°60.0°
HCB2CCBCBXCBT48.2°60.0°
HCB2CCBCBXHBX171.8°60.0°
HCB2CCBCBXHBX2165.7°180.0°
CBTCBXHBX1HBX2117.7°120.0°
CBXCBTCBQHBT1120.0°119.9°
CBXCBTCBQHBT2120.9°120.0°
CBXCBTHBT1HBT2120.9°120.0°
CBXCBTCBQCBN159.0°180.0°
CBXCBTCBQHBQ181.0°60.1°
CBXCBTCBQHBQ240.6°60.0°
HBX1CBXCBTCBQ20.9°60.0°
HBX1CBXCBTHBT1140.9°180.0°
HBX1CBXCBTHBT2100.0°60.0°
HBX2CBXCBTCBQ101.6°60.0°
HBX2CBXCBTHBT118.3°60.0°
HBX2CBXCBTHBT2137.5°180.0°
CBQCBTHBT1HBT2120.9°120.1°
CBTCBQCBNHBQ1120.0°120.0°
CBTCBQCBNHBQ2118.4°120.0°
CBTCBQHBQ1HBQ2118.5°120.0°
CBTCBQCBNCBK155.6°NaN°
CBTCBQCBNHBN184.4°60.0°
CBTCBQCBNHBN237.2°60.0°
HBT1CBTCBQCBN39.0°60.0°
HBT1CBTCBQHBQ1159.0°180.0°
HBT1CBTCBQHBQ279.4°59.9°
HBT2CBTCBQCBN80.1°60.1°
HBT2CBTCBQHBQ139.9°59.9°
HBT2CBTCBQHBQ2161.5°180.0°
CBNCBQHBQ1HBQ2118.5°120.1°
CBQCBNCBKHBN1120.0°120.0°
CBQCBNCBKHBN2118.4°119.9°
CBQCBNHBN1HBN2118.5°120.0°
CBQCBNCBKCBG170.1°NaN°
CBQCBNCBKHBK169.9°60.0°
CBQCBNCBKHBK250.9°60.0°
HBQ1CBQCBNCBK35.6°60.0°
HBQ1CBQCBNHBN1155.6°180.0°
HBQ1CBQCBNHBN282.9°59.9°
HBQ2CBQCBNCBK86.0°60.0°
HBQ2CBQCBNHBN134.0°59.9°
HBQ2CBQCBNHBN2155.6°180.0°
CBKCBNHBN1HBN2118.5°120.1°
CBNCBKCBGHBK1120.0°120.0°
CBNCBKCBGHBK2119.2°120.0°
CBNCBKHBK1HBK2119.2°120.0°
CBNCBKCBGCBA169.0°NaN°
CBNCBKCBGHBG171.0°60.0°
CBNCBKCBGHBG251.3°60.0°
HBN1CBNCBKCBG50.1°60.0°
HBN1CBNCBKHBK1170.1°180.0°
HBN1CBNCBKHBK269.1°59.9°
HBN2CBNCBKCBG71.5°60.1°
HBN2CBNCBKHBK148.5°59.9°
HBN2CBNCBKHBK2169.4°180.0°
CBGCBKHBK1HBK2119.2°120.1°
CBKCBGCBAHBG1120.0°120.0°
CBKCBGCBAHBG2117.7°119.9°
CBKCBGHBG1HBG2117.9°120.0°
CBKCBGCBACAU147.8°NaN°
CBKCBGCBAHBA127.8°60.0°
CBKCBGCBAHBA291.6°60.0°
HBK1CBKCBGCBA49.0°60.0°
HBK1CBKCBGHBG1169.0°180.0°
HBK1CBKCBGHBG268.7°59.9°
HBK2CBKCBGCBA71.8°60.0°
HBK2CBKCBGHBG148.2°59.9°
HBK2CBKCBGHBG2170.5°180.0°
CBACBGHBG1HBG2117.9°120.1°
CBGCBACAUHBA1120.0°119.9°
CBGCBACAUHBA2120.6°120.0°
CBGCBAHBA1HBA2120.6°120.0°
CBGCBACAUCAC150.6°180.0°
CBGCBACAUHAU130.6°60.0°
CBGCBACAUHAU291.0°60.0°
HBG1CBGCBACAU92.3°60.0°
HBG1CBGCBAHBA1147.7°180.0°
HBG1CBGCBAHBA228.4°60.0°
HBG2CBGCBACAU30.1°60.1°
HBG2CBGCBAHBA189.9°59.9°
HBG2CBGCBAHBA2150.7°180.0°
CAUCBAHBA1HBA2120.6°120.1°
CBACAUCACHAU1120.0°120.0°
CBACAUCACHAU2118.4°119.9°
CBACAUHAU1HAU2118.4°120.0°
CBACAUCACHAC180.4°60.0°
CBACAUCACHAC239.6°60.0°
CBACAUCACHAC3159.6°179.9°
HBA1CBACAUCAC89.3°60.0°
HBA1CBACAUHAU1150.7°179.9°
HBA1CBACAUHAU229.0°59.9°
HBA2CBACAUCAC30.0°60.1°
HBA2CBACAUHAU190.0°60.0°
HBA2CBACAUHAU2148.4°180.0°
CACCAUHAU1HAU2118.5°120.1°
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HBC2CBCCBEHBE164.1°60.0°
HBC2CBCCBEHBE256.6°180.0°
CAYCBEHBE1HBE2119.4°120.0°
CBECAYCASHAY1120.0°120.1°
CBECAYCASHAY2119.6°120.0°
CBECAYHAY1HAY2119.6°120.0°
CBECAYCASCAA168.1°180.0°
CBECAYCASHAS148.1°59.9°
CBECAYCASHAS272.0°60.0°
HBE1CBECAYCAS61.3°60.0°
HBE1CBECAYHAY1178.7°180.0°
HBE1CBECAYHAY258.3°60.0°
HBE2CBECAYCAS59.4°60.1°
HBE2CBECAYHAY160.6°60.0°
HBE2CBECAYHAY2179.0°180.0°
CASCAYHAY1HAY2119.6°119.9°
CAYCASCAAHAS1120.0°120.1°
CAYCASCAAHAS2119.9°120.0°
CAYCASHAS1HAS2119.9°119.9°
CAYCASCAAHAA151.5°60.0°
CAYCASCAAHAA268.6°179.9°
CAYCASCAAHAA3171.4°59.9°
HAY1CAYCASCAA71.9°59.9°
HAY1CAYCASHAS1168.1°180.0°
HAY1CAYCASHAS248.0°60.1°
HAY2CAYCASCAA48.5°60.0°
HAY2CAYCASHAS171.5°60.1°
HAY2CAYCASHAS2168.4°180.0°
CAACASHAS1HAS2119.9°120.0°
CASCAAHAA1HAA2120.0°120.1°
CASCAAHAA1HAA3120.0°120.0°
CASCAAHAA2HAA3120.0°120.1°
HAS1CASCAAHAA1171.5°60.1°
HAS1CASCAAHAA251.4°60.0°
HAS1CASCAAHAA368.6°180.0°
HAS2CASCAAHAA168.5°180.0°
HAS2CASCAAHAA2171.5°59.9°
HAS2CASCAAHAA351.5°60.1°
HAA1CAAHAA2HAA3120.0°119.9°

248942

PDB entries from 2026-02-11

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